SCHEMBL12261152

SCHEMBL12261152

C[C@@]1(O)[C@H](O)[C@@H](CO)O[C@H]1c1scc2c(N)ncnc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 4/20 0.47
▸ HIF1A Q16665 2/20 0.38
▸ PRMT5 O14744 3/20 0.36
▸ WDR77 Q9BQA1 3/20 0.36
▸ PI4KA P42356 2/20 0.35
▸ PI4K2B Q8TCG2 2/20 0.35
▸ PI4K2A Q9BTU6 2/20 0.35
▸ PI4KB Q9UBF8 2/20 0.35
▸ ADA P00813 1/20 0.34
▸ ADORA3 P0DMS8 4/20 0.34
▸ ADORA2B P29275 2/20 0.34
▸ ADORA1 P30542 2/20 0.34
▸ DPP4 P27487 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ SLC28A1 O00337 1/20 0.34
▸ MAP3K7 O43318 1/20 0.34
▸ SLC28A2 O43868 1/20 0.34
▸ GAPDH P04406 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ STAT6 P42226 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12261248 0.88 ADORA2A (0.40) ADORA2AHIF1API4KAPI4K2BPI4K2A
SCHEMBL12261229 0.84 ADORA2A (0.39) ADORA2AADA
SCHEMBL15898780 0.84 SMN1; SMN2 (0.39) ADORA2AHIF1API4KAPI4K2BPI4K2A
SCHEMBL15899073 0.84 SMN1; SMN2 (0.39) ADORA2AHIF1API4KAPI4K2BPI4K2A
SCHEMBL12261208 0.84 DNPH1 (0.41) ADORA1SMN1; SMN2
SCHEMBL12261214 0.81 PI4KA (0.37) ADORA2AHIF1API4KAPI4K2BPI4K2A
SCHEMBL264540 0.80 ADORA2A (0.47) ADORA2AHIF1API4KAPI4K2BPI4K2A
SCHEMBL264903 0.80 ADORA2A (0.47) ADORA2AHIF1API4KAPI4K2BPI4K2A
SCHEMBL12261199 0.79 P2RX1 (0.46) SMN1; SMN2
SCHEMBL3249984 0.78 ADORA2A (0.48) ADORA2AHIF1APRMT5WDR77PI4KA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8012942-B2 Carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-09-06 — — US disclosed
US-8012942-B2 Carba-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2011-09-06 — — US disclosed
WO-2010093608-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-19 — — WO disclosed
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-12 — — US disclosed
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2010-08-12 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100203015-A1 CARBA-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, TYMP, MTAP ADORA2A 116/4885HIF1A 3588/4885PRMT5 1496/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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